2-{[6-tert-butyl-3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid
Structure Info
- Chemspace ID
- CSSB00121676735 (In-Stock Building Blocks)
- MFCD
- MFCD01921742
- IUPAC Name
- 2-{[6-tert-butyl-3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid
- Mol formula
- C22H31NO5S
- Mol weight
- 422 Da
- Catalog Number(s)
- AA02WS82, AK-968/13408090, BW88702, CSC121676735, H48888, IVK/9022179, LN01181577, OSSL_212918, ST02WTRM, STK457913, TX02WTGI, UZI/9022179, Y6124354
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 6.05
- Heavy atoms count
- 29
- Rotatable bond count
- 6
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.681
- Polar surface area (Å)
- 93
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
![Chemical structure of 2-{[6-tert-butyl-3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexane-1-carboxylic acid (C22H31NO5S) - CSSB00121676735](/st/structure/200/8c1153967a45a5f881e78ff71ee01701/COC%2528%253DO%2529C1%253DC%2528NC%2528%253DO%2529C2CCCCC2C%2528O%2529%253DO%2529SC2%253DC1CCC%2528C2%2529C%2528C%2529%2528C%2529C.png "C22H31NO5S")
- Zoom the structure
- CSSB00121676735
Items Overall 1 item from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 14 days | United States To: | 90 | 10 mg | 245.30 | |
Description: 2-((6-(tert-butyl)-3-(methoxycarbonyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)carbamoyl)cyclohexanecarboxylic acid; CAS: 488821-89-2 | ||||||
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